N-(benzotriazol-1-ylmethyl)methanesulfonamide hydrate

Systemtic Name: N-(benzotriazol-1-ylmethyl)methanesulfonamide hydrate Openeye Name: N-(benzotriazol-1-ylmethyl)methanesulfonamide hydrate CAS Name: N-(1-benzotriazolylmethyl)methanesulfonamide hydrate IUPAC Name: N-(benzotriazol-1-ylmethyl)methanesulfonamide hydrate Traditional Name: N-(benzotriazol-1-ylmethyl)methanesulfonamide hydrate Formula: C8H12N4O3S MolecularWeight: 244.27088

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCN1C2=CC=CC=C2N=N1.O

Isomeric SMILES

CS(=O)(=O)NCN1C2=CC=CC=C2N=N1.O

InChI

InChI=1S/C8H10N4O2S.H2O/c1-15(13,14)9-6-12-8-5-3-2-4-7(8)10-11-12;/h2-5,9H,6H2,1H3;1H2